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Ab initio modelling of solute segregation energies to a general grain boundary, , , , and . Acta Materialia, (2017)Ab Initio Study of Advanced Metallic Nuclear Fuels for Fast Breeder Reactors, , , , , and . MRS Proceedings, (2012)Lattice Distortions in the FeCoNiCrMn High Entropy Alloy Studied by Theory and Experiment, , , , , , and . Entropy, 18 (9): 321 (2016)Atomic scale processes of phase transformations in nanocrystalline NiTi shape-memory alloys, , , , and . Acta Materialia, (2017)Ab initio thermodynamics of the CoCrFeMnNi high entropy alloy: Importance of entropy contributions beyond the configurational one, , , , and . Acta Materialia, (2015)Self-Healing Metals, and . page 387-407. Springer International Publishing, Cham, (2016)Advanced data mining in field ion microscopy, , , , , and . Materials Characterization, (2018)Ab initio assisted design of quinary dual-phase high-entropy alloys with transformation-induced plasticity, , , , and . Acta Materialia, (2017)Fast anharmonic free energy method with an application to vacancies in ZrC, , , and . Physical Review B, 100 (2): 024303 (July 2019)Performance of the standard exchange-correlation functionals in predicting melting properties fully from first principles : Application to Al and magnetic Ni, , , , and . Physical Review. B, 101 (14): 144108 (2020)